3-amino-2,2,3-trimethyl-N-quinoxalin-6-ylbutanamide

C15H20N4O — CID 65269314

IUPAC3-amino-2,2,3-trimethyl-N-quinoxalin-6-ylbutanamide
SMILESCC(C)(N)C(C)(C)C(=O)Nc1ccc2nccnc2c1
InChIInChI=1S/C15H20N4O/c1-14(2,15(3,4)16)13(20)19-10-5-6-11-12(9-10)18-8-7-17-11/h5-9H,16H2,1-4H3,(H,19,20)
InChIKeyPJCCCWWUGRNEAM-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.33
Rot. Bonds3

About 3-amino-2,2,3-trimethyl-N-quinoxalin-6-ylbutanamide

3-amino-2,2,3-trimethyl-N-quinoxalin-6-ylbutanamide (PubChem CID 65269314) has the molecular formula C15H20N4O and a molecular weight of 272.35 g/mol. Its IUPAC name is 3-amino-2,2,3-trimethyl-N-quinoxalin-6-ylbutanamide.

Molecular Properties

Compound Name3-amino-2,2,3-trimethyl-N-quinoxalin-6-ylbutanamide
PubChem CID65269314
Molecular FormulaC15H20N4O
Molecular Weight272.35 g/mol
Exact Mass272.16
IUPAC Name3-amino-2,2,3-trimethyl-N-quinoxalin-6-ylbutanamide
SMILESCC(C)(N)C(C)(C)C(=O)Nc1ccc2nccnc2c1
InChIInChI=1S/C15H20N4O/c1-14(2,15(3,4)16)13(20)19-10-5-6-11-12(9-10)18-8-7-17-11/h5-9H,16H2,1-4H3,(H,19,20)
InChIKeyPJCCCWWUGRNEAM-UHFFFAOYSA-N
XLogP2.33
TPSA80.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-2-amino-3,3-dimethyl-N-quinoxalin-6-ylbutanamide
CID 103929010
3-amino-2,2,3-trimethyl-N-(2-methyl-4-pyridinyl)butanamide
CID 79240943
3,3-dimethyl-N-quinoxalin-6-ylbutanamide
CID 47254889
N-(4-acetylphenyl)-3-amino-2,2,3-trimethylbutanamide
CID 65269737
3-[(3-amino-2,2,3-trimethylbutanoyl)amino]benzamide
CID 65269739
3-amino-N-(4-hydroxyphenyl)-2,2,3-trimethylbutanamide
CID 65264564
3-amino-2,2,3-trimethyl-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)butanamide
CID 65264454
2-amino-2-methyl-N-quinolin-6-ylpropanamide
CID 62636163
2-chloro-N-quinoxalin-6-ylpropanamide
CID 60933766
2-amino-2-methyl-N-quinolin-6-ylbutanamide
CID 79811443
3-(4-tert-butylphenyl)-N-quinoxalin-6-ylprop-2-enamide
CID 68870920
3-amino-N-[4-(diethylamino)phenyl]-2,2,3-trimethylbutanamide
CID 65265051

Frequently Asked Questions

What is the IUPAC name of 3-amino-2,2,3-trimethyl-N-quinoxalin-6-ylbutanamide?
The IUPAC name of 3-amino-2,2,3-trimethyl-N-quinoxalin-6-ylbutanamide (CID 65269314) is 3-amino-2,2,3-trimethyl-N-quinoxalin-6-ylbutanamide.
What is the SMILES notation for 3-amino-2,2,3-trimethyl-N-quinoxalin-6-ylbutanamide?
The canonical SMILES for 3-amino-2,2,3-trimethyl-N-quinoxalin-6-ylbutanamide is CC(C)(N)C(C)(C)C(=O)Nc1ccc2nccnc2c1.
What is the InChIKey of 3-amino-2,2,3-trimethyl-N-quinoxalin-6-ylbutanamide?
The InChIKey is PJCCCWWUGRNEAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O/c1-14(2,15(3,4)16)13(20)19-10-5-6-11-12(9-10)18-8-7-17-11/h5-9H,16H2,1-4H3,(H,19,20).
What are the key properties of 3-amino-2,2,3-trimethyl-N-quinoxalin-6-ylbutanamide?
3-amino-2,2,3-trimethyl-N-quinoxalin-6-ylbutanamide has a molecular weight of 272.35 g/mol, XLogP of 2.33, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-2,2,3-trimethyl-N-quinoxalin-6-ylbutanamide is sourced from PubChem (CID 65269314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).